867
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C11 | doub | 1.22Å | 1.21Å | |
| O1 | C3 | sing | 1.36Å | 1.38Å | |
| N8 | C25 | sing | 1.38Å | 1.34Å | |
| C2 | C3 | doub | 1.36Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.41Å | 1.40Å | Aromatic |
| C11 | C1 | sing | 1.48Å | 1.50Å | |
| C11 | O2 | sing | 1.35Å | 1.34Å | |
| C3 | C4 | sing | 1.41Å | 1.43Å | Aromatic |
| C1 | C6 | doub | 1.39Å | 1.38Å | Aromatic |
| N7 | C24 | sing | 1.35Å | 1.38Å | Aromatic |
| N7 | C23 | doub | 1.30Å | 1.31Å | Aromatic |
| O2 | C12 | sing | 1.45Å | 1.45Å | |
| C25 | C24 | doub | 1.41Å | 1.40Å | Aromatic |
| C25 | N9 | sing | 1.33Å | 1.35Å | Aromatic |
| C24 | C27 | sing | 1.40Å | 1.38Å | Aromatic |
| C4 | C7 | doub | 1.40Å | 1.42Å | Aromatic |
| C4 | C5 | sing | 1.42Å | 1.42Å | Aromatic |
| N9 | C26 | doub | 1.32Å | 1.33Å | Aromatic |
| C23 | N6 | sing | 1.36Å | 1.37Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.42Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C10 | doub | 1.41Å | 1.42Å | Aromatic |
| C27 | N6 | sing | 1.37Å | 1.37Å | Aromatic |
| C27 | N10 | doub | 1.33Å | 1.33Å | Aromatic |
| O4 | C13 | doub | 1.22Å | 1.23Å | |
| C26 | N10 | sing | 1.32Å | 1.32Å | Aromatic |
| N6 | C22 | sing | 1.47Å | 1.45Å | |
| C29 | N4 | sing | 1.47Å | 1.46Å | |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C8 | N1 | sing | 1.40Å | 1.42Å | |
| C8 | C9 | doub | 1.40Å | 1.40Å | Aromatic |
| N4 | C17 | sing | 1.37Å | 1.36Å | |
| C13 | N1 | sing | 1.35Å | 1.38Å | |
| C13 | N2 | sing | 1.35Å | 1.37Å | |
| C10 | C9 | sing | 1.36Å | 1.36Å | Aromatic |
| C30 | C18 | sing | 1.53Å | 1.53Å | |
| C14 | N2 | sing | 1.47Å | 1.46Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C22 | C21 | sing | 1.54Å | 1.54Å | |
| C22 | O7 | sing | 1.44Å | 1.42Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C21 | O6 | sing | 1.43Å | 1.43Å | |
| C21 | C20 | sing | 1.54Å | 1.53Å | |
| O7 | C19 | sing | 1.44Å | 1.45Å | |
| C15 | C16 | sing | 1.53Å | 1.55Å | |
| C17 | N5 | doub | 1.30Å | 1.28Å | |
| C17 | N3 | sing | 1.37Å | 1.36Å | |
| C19 | C20 | sing | 1.54Å | 1.53Å | |
| C16 | C28 | sing | 1.53Å | 1.54Å | |
| C20 | O5 | sing | 1.43Å | 1.42Å | |
| N3 | C28 | sing | 1.46Å | 1.46Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| N1 | H7 | sing | 0.97Å | 1.00Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.08Å | 1.08Å | |
| C26 | H32 | sing | 1.08Å | 1.08Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C29 | H36 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.09Å | 1.10Å | |
| C30 | H38 | sing | 1.09Å | 1.10Å | |
| C30 | H37 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C9 | H4 | sing | 1.08Å | 1.08Å | |
| N2 | H11 | sing | 0.97Å | 1.00Å | |
| N3 | H18 | sing | 0.97Å | 1.00Å | |
| N4 | H19 | sing | 0.97Å | 1.00Å | |
| N5 | H20 | sing | 0.97Å | 1.00Å | |
| N8 | H31 | sing | 0.97Å | 1.00Å | |
| N8 | H30 | sing | 0.97Å | 1.00Å | |
| O1 | H6 | sing | 0.97Å | 0.95Å | |
| O5 | H25 | sing | 0.97Å | 0.95Å | |
| O6 | H27 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C11 | C1 | 124.6° | 120.0° |
| O3 | C11 | O2 | 122.7° | 120.0° |
| O1 | C3 | C2 | 123.1° | 120.1° |
| O1 | C3 | C4 | 116.0° | 120.0° |
| C3 | O1 | H6 | 109.5° | 114.0° |
| N8 | C25 | C24 | 124.1° | 120.8° |
| N8 | C25 | N9 | 118.9° | 120.8° |
| C25 | N8 | H31 | 109.5° | 120.0° |
| C25 | N8 | H30 | 109.5° | 120.0° |
| C3 | C2 | C1 | 120.6° | 120.8° |
| C2 | C3 | C4 | 120.9° | 119.9° |
| C3 | C2 | H1 | 119.7° | 119.5° |
| C2 | C1 | C11 | 118.6° | 119.7° |
| C2 | C1 | C6 | 119.9° | 120.5° |
| C1 | C2 | H1 | 119.7° | 119.7° |
| C1 | C11 | O2 | 112.7° | 120.0° |
| C11 | C1 | C6 | 121.5° | 119.7° |
| C11 | O2 | C12 | 116.5° | 117.0° |
| C3 | C4 | C7 | 123.4° | 121.0° |
| C3 | C4 | C5 | 118.2° | 119.7° |
| C1 | C6 | C5 | 121.3° | 119.6° |
| C1 | C6 | H2 | 119.3° | 120.2° |
| C24 | N7 | C23 | 103.7° | 109.4° |
| N7 | C24 | C25 | 132.4° | 134.7° |
| N7 | C24 | C27 | 110.7° | 107.1° |
| N7 | C23 | N6 | 114.2° | 110.0° |
| N7 | C23 | H29 | 122.9° | 125.0° |
| O2 | C12 | H9 | 109.5° | 109.5° |
| O2 | C12 | H10 | 109.5° | 109.4° |
| O2 | C12 | H8 | 109.4° | 109.5° |
| C24 | C25 | N9 | 117.0° | 118.4° |
| C25 | C24 | C27 | 116.9° | 118.2° |
| C25 | N9 | C26 | 119.6° | 121.2° |
| C24 | C27 | N6 | 105.8° | 106.0° |
| C24 | C27 | N10 | 126.9° | 119.1° |
| C7 | C4 | C5 | 118.3° | 119.4° |
| C4 | C7 | C8 | 121.4° | 119.6° |
| C4 | C7 | H3 | 119.3° | 120.2° |
| C4 | C5 | C6 | 119.0° | 119.5° |
| C4 | C5 | C10 | 118.7° | 119.5° |
| N9 | C26 | N10 | 128.6° | 122.5° |
| N9 | C26 | H32 | 115.7° | 118.7° |
| C23 | N6 | C27 | 105.6° | 107.5° |
| C23 | N6 | C22 | 127.2° | 126.2° |
| N6 | C23 | H29 | 122.9° | 125.1° |
| C6 | C5 | C10 | 122.3° | 121.0° |
| C5 | C6 | H2 | 119.4° | 120.2° |
| C7 | C8 | N1 | 120.9° | 119.7° |
| C7 | C8 | C9 | 119.2° | 120.7° |
| C8 | C7 | H3 | 119.3° | 120.2° |
| C5 | C10 | C9 | 121.0° | 119.9° |
| C5 | C10 | H5 | 119.5° | 120.0° |
| N6 | C27 | N10 | 127.3° | 134.9° |
| C27 | N6 | C22 | 127.1° | 126.3° |
| C27 | N10 | C26 | 111.0° | 120.6° |
| O4 | C13 | N1 | 122.7° | 120.0° |
| O4 | C13 | N2 | 121.9° | 120.0° |
| N10 | C26 | H32 | 115.7° | 118.8° |
| N6 | C22 | C21 | 114.7° | 110.4° |
| N6 | C22 | O7 | 108.5° | 110.4° |
| N6 | C22 | H28 | 109.4° | 110.4° |
| N4 | C29 | C30 | 112.2° | 109.5° |
| C29 | N4 | C17 | 123.6° | 120.0° |
| N4 | C29 | H36 | 108.8° | 109.5° |
| N4 | C29 | H35 | 108.8° | 109.5° |
| C29 | N4 | H19 | 118.2° | 120.0° |
| C29 | C30 | C18 | 111.6° | 109.5° |
| C30 | C29 | H36 | 108.8° | 109.5° |
| C30 | C29 | H35 | 108.8° | 109.5° |
| C29 | C30 | H38 | 108.9° | 109.5° |
| C29 | C30 | H37 | 109.0° | 109.5° |
| N1 | C8 | C9 | 119.7° | 119.6° |
| C8 | N1 | C13 | 128.7° | 120.0° |
| C8 | N1 | H7 | 115.6° | 120.0° |
| C8 | C9 | C10 | 121.2° | 120.9° |
| C8 | C9 | H4 | 119.4° | 119.5° |
| N4 | C17 | N5 | 113.8° | 120.0° |
| N4 | C17 | N3 | 120.3° | 120.0° |
| C17 | N4 | H19 | 118.2° | 120.0° |
| N1 | C13 | N2 | 115.5° | 120.0° |
| C13 | N1 | H7 | 115.7° | 120.0° |
| C13 | N2 | C14 | 122.6° | 120.0° |
| C13 | N2 | H11 | 118.7° | 120.0° |
| C9 | C10 | H5 | 119.5° | 120.0° |
| C10 | C9 | H4 | 119.4° | 119.6° |
| C30 | C18 | C19 | 115.3° | 109.5° |
| C30 | C18 | H21 | 108.0° | 109.5° |
| C30 | C18 | H22 | 108.0° | 109.5° |
| C18 | C30 | H38 | 109.0° | 109.4° |
| C18 | C30 | H37 | 108.9° | 109.5° |
| N2 | C14 | C15 | 111.7° | 109.5° |
| N2 | C14 | H13 | 108.9° | 109.5° |
| N2 | C14 | H12 | 108.9° | 109.4° |
| C14 | N2 | H11 | 118.7° | 120.0° |
| C14 | C15 | C16 | 116.0° | 109.5° |
| C15 | C14 | H13 | 108.9° | 109.5° |
| C15 | C14 | H12 | 108.9° | 109.5° |
| C14 | C15 | H15 | 107.8° | 109.5° |
| C14 | C15 | H14 | 107.8° | 109.4° |
| C21 | C22 | O7 | 106.0° | 104.8° |
| C22 | C21 | O6 | 116.0° | 110.5° |
| C22 | C21 | C20 | 98.2° | 104.1° |
| C22 | C21 | H26 | 109.5° | 110.7° |
| C21 | C22 | H28 | 108.2° | 110.4° |
| C22 | O7 | C19 | 109.4° | 105.3° |
| O7 | C22 | H28 | 109.9° | 110.4° |
| C18 | C19 | O7 | 109.2° | 110.4° |
| C18 | C19 | C20 | 115.4° | 110.4° |
| C19 | C18 | H21 | 108.0° | 109.5° |
| C19 | C18 | H22 | 108.0° | 109.5° |
| C18 | C19 | H23 | 108.9° | 110.3° |
| O6 | C21 | C20 | 111.7° | 110.5° |
| O6 | C21 | H26 | 111.1° | 110.4° |
| C21 | O6 | H27 | 109.5° | 114.0° |
| C21 | C20 | C19 | 101.2° | 104.1° |
| C21 | C20 | O5 | 111.8° | 110.5° |
| C21 | C20 | H24 | 110.0° | 110.6° |
| C20 | C21 | H26 | 109.6° | 110.5° |
| O7 | C19 | C20 | 104.6° | 104.8° |
| O7 | C19 | H23 | 109.9° | 110.5° |
| C15 | C16 | C28 | 112.5° | 109.5° |
| C15 | C16 | H17 | 108.7° | 109.4° |
| C15 | C16 | H16 | 108.7° | 109.4° |
| C16 | C15 | H15 | 107.8° | 109.5° |
| C16 | C15 | H14 | 107.8° | 109.5° |
| N5 | C17 | N3 | 125.9° | 120.0° |
| C17 | N5 | H20 | 112.0° | 120.0° |
| C17 | N3 | C28 | 121.3° | 120.0° |
| C17 | N3 | H18 | 119.4° | 119.9° |
| C19 | C20 | O5 | 111.6° | 110.5° |
| C20 | C19 | H23 | 108.8° | 110.4° |
| C19 | C20 | H24 | 110.1° | 110.5° |
| C16 | C28 | N3 | 112.2° | 109.5° |
| C28 | C16 | H17 | 108.7° | 109.5° |
| C28 | C16 | H16 | 108.7° | 109.5° |
| C16 | C28 | H33 | 108.8° | 109.4° |
| C16 | C28 | H34 | 108.8° | 109.5° |
| O5 | C20 | H24 | 111.6° | 110.4° |
| C20 | O5 | H25 | 109.5° | 114.0° |
| N3 | C28 | H33 | 108.8° | 109.5° |
| N3 | C28 | H34 | 108.8° | 109.5° |
| C28 | N3 | H18 | 119.4° | 120.0° |
| H9 | C12 | H10 | 109.5° | 109.4° |
| H9 | C12 | H8 | 109.5° | 109.5° |
| H10 | C12 | H8 | 109.5° | 109.5° |
| H17 | C16 | H16 | 109.5° | 109.5° |
| H13 | C14 | H12 | 109.5° | 109.5° |
| H15 | C15 | H14 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.5° |
| H33 | C28 | H34 | 109.5° | 109.5° |
| H36 | C29 | H35 | 109.5° | 109.5° |
| H38 | C30 | H37 | 109.4° | 109.5° |
| H31 | N8 | H30 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C11 | C1 | C2 | 18.6° | 179.7° |
| O3 | C11 | C1 | O2 | 179.8° | 180.0° |
| O3 | C11 | C1 | C6 | 160.9° | 0.0° |
| O3 | C11 | O2 | C12 | 89.5° | 0.0° |
| O1 | C3 | C2 | C4 | 179.8° | 179.9° |
| O1 | C3 | C2 | C1 | 179.9° | 180.0° |
| O1 | C3 | C4 | C7 | 0.2° | 0.0° |
| O1 | C3 | C4 | C5 | 179.9° | 180.0° |
| O1 | C3 | C2 | H1 | 0.1° | 0.1° |
| N8 | C25 | C24 | N7 | 0.5° | 0.5° |
| N8 | C25 | C24 | N9 | 179.9° | 180.0° |
| N8 | C25 | C24 | C27 | 179.8° | 180.0° |
| N8 | C25 | N9 | C26 | 180.0° | 180.0° |
| C25 | N8 | H31 | H30 | 120.0° | 179.9° |
| C3 | C2 | C1 | H1 | 180.0° | 179.9° |
| C3 | C2 | C1 | C11 | 179.8° | 179.8° |
| C3 | C2 | C1 | C6 | 0.3° | 0.0° |
| C2 | C3 | C4 | C7 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C2 | C3 | O1 | H6 | 180.0° | 89.9° |
| C2 | C1 | C11 | C6 | 179.5° | 179.7° |
| C2 | C1 | C11 | O2 | 161.2° | 0.3° |
| C1 | C2 | C3 | C4 | 0.1° | 0.0° |
| C2 | C1 | C6 | C5 | 0.4° | 0.0° |
| C2 | C1 | C6 | H2 | 179.6° | 180.0° |
| C1 | C11 | O2 | C12 | 90.2° | 180.0° |
| C11 | C1 | C6 | C5 | 180.0° | 179.7° |
| C11 | C1 | C2 | H1 | 0.2° | 0.3° |
| C11 | C1 | C6 | H2 | 0.0° | 0.3° |
| O2 | C11 | C1 | C6 | 19.3° | 180.0° |
| C11 | O2 | C12 | H9 | 180.0° | 180.0° |
| C11 | O2 | C12 | H10 | 60.0° | 60.0° |
| C11 | O2 | C12 | H8 | 60.0° | 59.9° |
| C3 | C4 | C7 | C5 | 179.9° | 180.0° |
| C3 | C4 | C5 | C6 | 0.2° | 0.0° |
| C3 | C4 | C7 | C8 | 178.8° | 180.0° |
| C3 | C4 | C5 | C10 | 179.9° | 180.0° |
| C4 | C3 | C2 | H1 | 179.9° | 180.0° |
| C3 | C4 | C7 | H3 | 1.2° | 0.0° |
| C4 | C3 | O1 | H6 | 0.2° | 90.0° |
| C1 | C6 | C5 | C4 | 0.4° | 0.0° |
| C1 | C6 | C5 | H2 | 180.0° | 180.0° |
| C1 | C6 | C5 | C10 | 179.7° | 180.0° |
| C6 | C1 | C2 | H1 | 179.7° | 180.0° |
| N7 | C24 | C25 | C27 | 179.3° | 179.4° |
| N7 | C24 | C25 | N9 | 179.4° | 179.5° |
| C24 | N7 | C23 | N6 | 0.6° | 0.1° |
| N7 | C24 | C27 | N6 | 0.6° | 0.4° |
| N7 | C24 | C27 | N10 | 179.6° | 179.6° |
| C24 | N7 | C23 | H29 | 179.4° | 179.7° |
| C23 | N7 | C24 | C25 | 179.9° | 179.7° |
| C23 | N7 | C24 | C27 | 0.7° | 0.2° |
| N7 | C23 | N6 | H29 | 180.0° | 179.6° |
| N7 | C23 | N6 | C27 | 0.2° | 0.3° |
| N7 | C23 | N6 | C22 | 179.4° | 179.7° |
| O2 | C12 | H9 | H10 | 120.0° | 119.9° |
| O2 | C12 | H9 | H8 | 120.0° | 120.1° |
| O2 | C12 | H10 | H8 | 120.0° | 120.0° |
| C24 | C25 | N9 | C26 | 0.1° | 0.0° |
| C25 | C24 | C27 | N6 | 179.9° | 180.0° |
| C25 | C24 | C27 | N10 | 0.1° | 0.0° |
| C24 | C25 | N8 | H31 | 179.9° | 0.0° |
| C24 | C25 | N8 | H30 | 60.1° | 180.0° |
| N9 | C25 | C24 | C27 | 0.1° | 0.0° |
| C25 | N9 | C26 | N10 | 0.4° | 0.0° |
| C25 | N9 | C26 | H32 | 179.6° | 180.0° |
| N9 | C25 | N8 | H31 | 0.0° | 180.0° |
| N9 | C25 | N8 | H30 | 120.0° | 0.0° |
| C24 | C27 | N6 | C23 | 0.3° | 0.4° |
| C24 | C27 | N6 | N10 | 179.8° | 180.0° |
| C24 | C27 | N10 | C26 | 0.1° | 0.0° |
| C24 | C27 | N6 | C22 | 179.9° | 179.6° |
| C7 | C4 | C5 | C6 | 179.9° | 180.0° |
| C4 | C7 | C8 | H3 | 180.0° | 180.0° |
| C7 | C4 | C5 | C10 | 0.0° | 0.0° |
| C4 | C7 | C8 | N1 | 177.4° | 180.0° |
| C4 | C7 | C8 | C9 | 2.6° | 0.1° |
| C4 | C5 | C6 | C10 | 179.9° | 180.0° |
| C5 | C4 | C7 | C8 | 1.3° | 0.0° |
| C4 | C5 | C10 | C9 | 0.0° | 0.1° |
| C4 | C5 | C6 | H2 | 179.6° | 180.0° |
| C4 | C5 | C10 | H5 | 179.9° | 179.9° |
| C5 | C4 | C7 | H3 | 178.7° | 180.0° |
| N9 | C26 | N10 | C27 | 0.3° | 0.0° |
| N9 | C26 | N10 | H32 | 180.0° | 180.0° |
| C23 | N6 | C27 | C22 | 179.6° | 180.0° |
| C23 | N6 | C27 | N10 | 179.9° | 179.5° |
| C23 | N6 | C22 | C21 | 47.4° | 94.9° |
| C23 | N6 | C22 | O7 | 71.0° | 20.4° |
| C23 | N6 | C22 | H28 | 169.2° | 142.8° |
| C6 | C5 | C10 | C9 | 179.9° | 179.9° |
| C6 | C5 | C10 | H5 | 0.0° | 0.1° |
| C7 | C8 | N1 | C9 | 174.8° | 179.9° |
| C7 | C8 | N1 | C13 | 47.2° | 146.4° |
| C7 | C8 | C9 | C10 | 2.6° | 0.1° |
| C7 | C8 | N1 | H7 | 132.7° | 33.7° |
| C7 | C8 | C9 | H4 | 177.3° | 180.0° |
| C5 | C10 | C9 | C8 | 1.4° | 0.0° |
| C5 | C10 | C9 | H5 | 180.0° | 180.0° |
| C10 | C5 | C6 | H2 | 0.3° | 0.0° |
| C5 | C10 | C9 | H4 | 178.6° | 180.0° |
| N6 | C27 | N10 | C26 | 179.7° | 180.0° |
| C27 | N6 | C22 | C21 | 132.2° | 85.0° |
| C27 | N6 | C22 | O7 | 109.5° | 159.6° |
| C27 | N6 | C22 | H28 | 10.4° | 37.3° |
| C27 | N6 | C23 | H29 | 179.8° | 179.9° |
| N10 | C27 | N6 | C22 | 0.3° | 0.4° |
| C27 | N10 | C26 | H32 | 179.7° | 180.0° |
| O4 | C13 | N1 | C8 | 3.5° | 5.3° |
| O4 | C13 | N1 | N2 | 179.5° | 179.9° |
| O4 | C13 | N2 | C14 | 2.4° | 0.0° |
| O4 | C13 | N1 | H7 | 176.5° | 174.8° |
| O4 | C13 | N2 | H11 | 177.6° | 180.0° |
| N6 | C22 | C21 | O7 | 119.8° | 118.8° |
| N6 | C22 | C21 | H28 | 122.4° | 122.3° |
| N6 | C22 | O7 | H28 | 119.5° | 122.3° |
| N6 | C22 | C21 | O6 | 82.5° | 98.5° |
| N6 | C22 | C21 | C20 | 158.4° | 142.8° |
| N6 | C22 | O7 | C19 | 141.6° | 159.3° |
| N6 | C22 | C21 | H26 | 44.2° | 24.1° |
| C22 | N6 | C23 | H29 | 0.6° | 0.1° |
| N4 | C29 | C30 | H36 | 120.4° | 120.0° |
| N4 | C29 | C30 | H35 | 120.4° | 120.0° |
| C29 | N4 | C17 | H19 | 180.0° | 179.9° |
| N4 | C29 | C30 | C18 | 64.5° | 180.0° |
| C29 | N4 | C17 | N5 | 35.3° | 0.0° |
| C29 | N4 | C17 | N3 | 146.9° | 180.0° |
| N4 | C29 | H36 | H35 | 118.7° | 120.0° |
| N4 | C29 | C30 | H38 | 55.8° | 60.0° |
| N4 | C29 | C30 | H37 | 175.2° | 60.0° |
| C30 | C29 | N4 | C17 | 61.6° | 180.0° |
| C29 | C30 | C18 | H38 | 120.3° | 120.0° |
| C29 | C30 | C18 | H37 | 120.3° | 120.0° |
| C29 | C30 | C18 | C19 | 179.2° | 180.0° |
| C29 | C30 | C18 | H21 | 59.9° | 60.0° |
| C29 | C30 | C18 | H22 | 58.4° | 60.0° |
| C30 | C29 | H36 | H35 | 118.8° | 120.0° |
| C29 | C30 | H38 | H37 | 119.0° | 120.0° |
| C30 | C29 | N4 | H19 | 118.3° | 0.1° |
| C8 | N1 | C13 | H7 | 180.0° | 180.0° |
| C8 | N1 | C13 | N2 | 176.1° | 174.7° |
| N1 | C8 | C9 | C10 | 177.5° | 180.0° |
| N1 | C8 | C7 | H3 | 2.6° | 0.0° |
| N1 | C8 | C9 | H4 | 2.5° | 0.0° |
| C9 | C8 | N1 | C13 | 138.0° | 33.7° |
| C8 | C9 | C10 | H4 | 180.0° | 180.0° |
| C9 | C8 | N1 | H7 | 42.0° | 146.2° |
| C8 | C9 | C10 | H5 | 178.6° | 180.0° |
| C9 | C8 | C7 | H3 | 177.4° | 179.9° |
| N4 | C17 | N5 | N3 | 177.7° | 180.0° |
| N4 | C17 | N3 | C28 | 139.5° | 180.0° |
| C17 | N4 | C29 | H36 | 58.8° | 60.0° |
| C17 | N4 | C29 | H35 | 177.9° | 60.0° |
| N4 | C17 | N3 | H18 | 40.5° | 0.0° |
| N4 | C17 | N5 | H20 | 177.7° | 180.0° |
| N1 | C13 | N2 | C14 | 178.1° | 180.0° |
| N1 | C13 | N2 | H11 | 1.9° | 0.0° |
| C13 | N2 | C14 | H11 | 180.0° | 180.0° |
| C13 | N2 | C14 | C15 | 71.4° | 180.0° |
| N2 | C13 | N1 | H7 | 3.9° | 5.3° |
| C13 | N2 | C14 | H13 | 168.3° | 60.0° |
| C13 | N2 | C14 | H12 | 49.0° | 60.0° |
| C30 | C18 | C19 | H21 | 120.8° | 120.0° |
| C30 | C18 | C19 | H22 | 120.8° | 120.0° |
| C30 | C18 | C19 | O7 | 74.8° | 69.6° |
| C30 | C18 | C19 | C20 | 167.8° | 175.0° |
| C30 | C18 | H21 | H22 | 117.3° | 120.0° |
| C30 | C18 | C19 | H23 | 45.2° | 52.8° |
| C18 | C30 | C29 | H36 | 175.1° | 60.0° |
| C18 | C30 | C29 | H35 | 55.9° | 60.0° |
| C18 | C30 | H38 | H37 | 119.0° | 120.0° |
| N2 | C14 | C15 | H13 | 120.3° | 120.0° |
| N2 | C14 | C15 | H12 | 120.3° | 119.9° |
| N2 | C14 | C15 | C16 | 143.6° | 180.0° |
| N2 | C14 | H13 | H12 | 119.0° | 119.9° |
| N2 | C14 | C15 | H15 | 95.5° | 59.9° |
| N2 | C14 | C15 | H14 | 22.6° | 60.1° |
| C14 | C15 | C16 | H15 | 121.0° | 120.0° |
| C14 | C15 | C16 | H14 | 120.9° | 119.9° |
| C14 | C15 | C16 | C28 | 156.5° | NaN° |
| C14 | C15 | C16 | H17 | 36.1° | 60.0° |
| C14 | C15 | C16 | H16 | 83.0° | 59.9° |
| C15 | C14 | H13 | H12 | 119.0° | 120.0° |
| C14 | C15 | H15 | H14 | 117.0° | 120.0° |
| C15 | C14 | N2 | H11 | 108.6° | 0.0° |
| C21 | C22 | O7 | H28 | 116.7° | 118.8° |
| C22 | C21 | O6 | C20 | 111.4° | 114.6° |
| C22 | C21 | O6 | H26 | 125.9° | 122.8° |
| C22 | C21 | C20 | H26 | 114.1° | 118.8° |
| C21 | C22 | O7 | C19 | 17.9° | 40.5° |
| C22 | C21 | C20 | C19 | 43.6° | 0.0° |
| C22 | C21 | C20 | O5 | 75.4° | 118.7° |
| C22 | C21 | C20 | H24 | 160.0° | 118.7° |
| C22 | C21 | O6 | H27 | 180.0° | 176.1° |
| C22 | O7 | C19 | C18 | 113.0° | 159.3° |
| O7 | C22 | C21 | O6 | 157.7° | 142.6° |
| O7 | C22 | C21 | C20 | 38.6° | 24.0° |
| C22 | O7 | C19 | C20 | 11.0° | 40.5° |
| C22 | O7 | C19 | H23 | 127.7° | 78.4° |
| O7 | C22 | C21 | H26 | 75.6° | 94.8° |
| C18 | C19 | C20 | C21 | 84.7° | 142.8° |
| C18 | C19 | O7 | C20 | 124.0° | 118.8° |
| C18 | C19 | O7 | H23 | 119.3° | 122.3° |
| C18 | C19 | C20 | H23 | 122.6° | 122.2° |
| C18 | C19 | C20 | O5 | 156.2° | 98.5° |
| C19 | C18 | H21 | H22 | 117.4° | 120.0° |
| C18 | C19 | C20 | H24 | 31.6° | 24.0° |
| C19 | C18 | C30 | H38 | 58.9° | 60.0° |
| C19 | C18 | C30 | H37 | 60.5° | 60.0° |
| O6 | C21 | C20 | H26 | 123.6° | 122.5° |
| O6 | C21 | C20 | C19 | 165.9° | 118.7° |
| O6 | C21 | C20 | O5 | 47.0° | 0.0° |
| O6 | C21 | C20 | H24 | 77.7° | 122.6° |
| O6 | C21 | C22 | H28 | 39.9° | 23.8° |
| C21 | C20 | C19 | O7 | 35.2° | 23.9° |
| C21 | C20 | C19 | O5 | 119.1° | 118.7° |
| C21 | C20 | C19 | H24 | 116.4° | 118.8° |
| C21 | C20 | O5 | H24 | 123.7° | 122.7° |
| C21 | C20 | C19 | H23 | 152.6° | 95.0° |
| C20 | C21 | C22 | H28 | 79.2° | 94.8° |
| C21 | C20 | O5 | H25 | 180.0° | 65.3° |
| C20 | C21 | O6 | H27 | 68.6° | 61.5° |
| O7 | C19 | C20 | H23 | 117.4° | 118.9° |
| O7 | C19 | C20 | O5 | 83.9° | 142.6° |
| O7 | C19 | C18 | H21 | 46.0° | 170.4° |
| O7 | C19 | C18 | H22 | 164.4° | 50.4° |
| O7 | C19 | C20 | H24 | 151.6° | 94.9° |
| C19 | O7 | C22 | H28 | 98.9° | 78.3° |
| C15 | C16 | C28 | H17 | 120.5° | 119.9° |
| C15 | C16 | C28 | H16 | 120.4° | 120.0° |
| C15 | C16 | C28 | N3 | 73.0° | 180.0° |
| C15 | C16 | H17 | H16 | 118.6° | 119.9° |
| C16 | C15 | C14 | H13 | 23.3° | 60.0° |
| C16 | C15 | C14 | H12 | 96.1° | 60.1° |
| C16 | C15 | H15 | H14 | 117.0° | 120.0° |
| C15 | C16 | C28 | H33 | 47.4° | 60.0° |
| C15 | C16 | C28 | H34 | 166.6° | 60.0° |
| N5 | C17 | N3 | C28 | 38.1° | 0.0° |
| N5 | C17 | N3 | H18 | 142.0° | 180.0° |
| N5 | C17 | N4 | H19 | 144.7° | 179.9° |
| C17 | N3 | C28 | C16 | 65.4° | 180.0° |
| C17 | N3 | C28 | H18 | 180.0° | 180.0° |
| C17 | N3 | C28 | H33 | 174.2° | 60.1° |
| C17 | N3 | C28 | H34 | 55.0° | 60.0° |
| N3 | C17 | N4 | H19 | 33.1° | 0.0° |
| N3 | C17 | N5 | H20 | 0.0° | 0.0° |
| C19 | C20 | O5 | H24 | 123.7° | 122.6° |
| C20 | C19 | C18 | H21 | 71.4° | 55.0° |
| C20 | C19 | C18 | H22 | 47.0° | 65.0° |
| C19 | C20 | C21 | H26 | 70.5° | 118.8° |
| C19 | C20 | O5 | H25 | 67.4° | 180.0° |
| C16 | C28 | N3 | H33 | 120.4° | 119.9° |
| C16 | C28 | N3 | H34 | 120.4° | 120.0° |
| C28 | C16 | H17 | H16 | 118.6° | 120.1° |
| C28 | C16 | C15 | H15 | 82.5° | 60.0° |
| C28 | C16 | C15 | H14 | 35.6° | 60.1° |
| C16 | C28 | H33 | H34 | 118.8° | 120.0° |
| C16 | C28 | N3 | H18 | 114.6° | 0.0° |
| O5 | C20 | C19 | H23 | 33.5° | 23.7° |
| O5 | C20 | C21 | H26 | 170.5° | 122.5° |
| N3 | C28 | C16 | H17 | 166.5° | 60.1° |
| N3 | C28 | C16 | H16 | 47.4° | 60.0° |
| N3 | C28 | H33 | H34 | 118.8° | 120.0° |
| H9 | C12 | H10 | H8 | 120.0° | 120.0° |
| H17 | C16 | C15 | H15 | 157.0° | 60.0° |
| H17 | C16 | C15 | H14 | 84.9° | 180.0° |
| H17 | C16 | C28 | H33 | 73.1° | 180.0° |
| H17 | C16 | C28 | H34 | 46.1° | 60.0° |
| H16 | C16 | C15 | H15 | 37.9° | 180.0° |
| H16 | C16 | C15 | H14 | 156.0° | 60.0° |
| H16 | C16 | C28 | H33 | 167.8° | 60.0° |
| H16 | C16 | C28 | H34 | 73.0° | 180.0° |
| H5 | C10 | C9 | H4 | 1.4° | 0.0° |
| H13 | C14 | C15 | H15 | 144.2° | 180.0° |
| H13 | C14 | C15 | H14 | 97.7° | 60.0° |
| H13 | C14 | N2 | H11 | 11.7° | 120.0° |
| H12 | C14 | C15 | H15 | 24.9° | 60.0° |
| H12 | C14 | C15 | H14 | 143.0° | 180.0° |
| H12 | C14 | N2 | H11 | 131.0° | 120.0° |
| H21 | C18 | C19 | H23 | 166.0° | 67.2° |
| H21 | C18 | C30 | H38 | 179.7° | 180.0° |
| H21 | C18 | C30 | H37 | 60.4° | 60.0° |
| H22 | C18 | C19 | H23 | 75.6° | 172.8° |
| H22 | C18 | C30 | H38 | 62.0° | 60.0° |
| H22 | C18 | C30 | H37 | 178.7° | 180.0° |
| H23 | C19 | C20 | H24 | 91.0° | 146.2° |
| H24 | C20 | C21 | H26 | 45.9° | 0.1° |
| H24 | C20 | O5 | H25 | 56.3° | 57.5° |
| H26 | C21 | C22 | H28 | 166.5° | 146.4° |
| H26 | C21 | O6 | H27 | 54.2° | 61.1° |
| H33 | C28 | N3 | H18 | 5.8° | 120.0° |
| H34 | C28 | N3 | H18 | 125.0° | 120.0° |
| H36 | C29 | C30 | H38 | 64.6° | 180.0° |
| H36 | C29 | C30 | H37 | 54.8° | 60.0° |
| H36 | C29 | N4 | H19 | 121.3° | 120.1° |
| H35 | C29 | C30 | H38 | 176.2° | 60.0° |
| H35 | C29 | C30 | H37 | 64.4° | 180.0° |
| H35 | C29 | N4 | H19 | 2.1° | 120.0° |
